Geometry & MOs

Info

ID:	367762
PubChem CID:	127325735
Reduced:	SF2O2N3C19H19 (1)
Stoich.:	AB2C2D3E19F19 (1)
Weight, g/mol:	383.166748
ΔH_f, kcal/mol:	-121.08
Dipole, Da:	6.28
IP(EA), eV:	-8.96(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylphenyl)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)C3CC(=O)N(C3)C4=C(C=C(C=C4)F)F

DOS

IR

Vibrations